2-[1-(2-methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol

C15H29NO — CID 114339035

IUPAC2-[1-(2-methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol
SMILESCCCC(C)CN1CCCC1C1CCCC1O
InChIInChI=1S/C15H29NO/c1-3-6-12(2)11-16-10-5-8-14(16)13-7-4-9-15(13)17/h12-15,17H,3-11H2,1-2H3
InChIKeyUJZHUUMOPFZCLL-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.05
Rot. Bonds5

About 2-[1-(2-methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol

2-[1-(2-methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol (PubChem CID 114339035) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 2-[1-(2-methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[1-(2-methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol
PubChem CID114339035
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name2-[1-(2-methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol
SMILESCCCC(C)CN1CCCC1C1CCCC1O
InChIInChI=1S/C15H29NO/c1-3-6-12(2)11-16-10-5-8-14(16)13-7-4-9-15(13)17/h12-15,17H,3-11H2,1-2H3
InChIKeyUJZHUUMOPFZCLL-UHFFFAOYSA-N
XLogP3.05
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol?
The IUPAC name of 2-[1-(2-methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol (CID 114339035) is 2-[1-(2-methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol.
What is the SMILES notation for 2-[1-(2-methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol?
The canonical SMILES for 2-[1-(2-methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol is CCCC(C)CN1CCCC1C1CCCC1O.
What is the InChIKey of 2-[1-(2-methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol?
The InChIKey is UJZHUUMOPFZCLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-3-6-12(2)11-16-10-5-8-14(16)13-7-4-9-15(13)17/h12-15,17H,3-11H2,1-2H3.
What are the key properties of 2-[1-(2-methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol?
2-[1-(2-methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol has a molecular weight of 239.40 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-methylpentyl)pyrrolidin-2-yl]cyclopentan-1-ol is sourced from PubChem (CID 114339035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).